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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 100722Generated: October 26, 2026

1-(1,3-Dioxobutyl)pyrrolidine

1-(3-Oxobutanoyl)pyrrolidine · 1-(1,3-dioxobutyl)pyrrolidine · 1-Pyrrolizino-1,3-butanedione · 1,3-Butanedione, 1-(1-pyrrolidinyl)-

https://huagongshe.com/en/chemical/100722

1-(1,3-Dioxobutyl)pyrrolidine molecular structure

Identifiers & Physical Properties

CAS No.41153-96-2
Molecular formulaC8H13NO2
Average molar mass155.19 g/mol
Monoisotopic mass155.09462866 g/mol
SMILESCC(=O)CC(=O)N1CCCC1
InChIKeyGOHRQEHMWBECSS-UHFFFAOYSA-N
PubChem CID100722
EC No.255-242-1
DTXSIDDTXSID10194085

Chemical & Physical Properties

XLogP0.1
Topological polar surface area37.4
Hydrogen bond donors0
Hydrogen bond acceptors2
Rotatable bonds2
Heavy atoms11
Formal charge0
Complexity171
Boiling point292.4±23.0 °C(Predicted)
Density1.099±0.06 g/cm3(Predicted)
pKa (acidity coefficient)12.97±0.20(Predicted)